EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C42H68N2O2 |
| Net Charge | 0 |
| Average Mass | 633.018 |
| Monoisotopic Mass | 632.52808 |
| SMILES | [H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])CC[C@]4(C)O)[C@@]1(C)C[C@@H](C)/C(=N/N=C1\C[C@]3([H])CC[C@]4([H])[C@]([H])(CC[C@@]5(C)[C@@]4([H])CC[C@]5(C)O)[C@@]3(C)C[C@H]1C)C2 |
| InChI | InChI=1S/C42H68N2O2/c1-25-23-37(3)27(9-11-29-31(37)13-17-39(5)33(29)15-19-41(39,7)45)21-35(25)43-44-36-22-28-10-12-30-32(38(28,4)24-26(36)2)14-18-40(6)34(30)16-20-42(40,8)46/h25-34,45-46H,9-24H2,1-8H3/b43-35+,44-36+/t25-,26-,27+,28+,29-,30-,31+,32+,33+,34+,37+,38+,39+,40+,41+,42+/m1/s1 |
| InChIKey | POPWFGNRCCUJGU-RSSVFQIBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| mebolazine (CHEBI:750824) is a androstanoid (CHEBI:50402) |
| INNs | Source |
|---|---|
| mebolazina | WHO MedNet |
| mebolazine | WHO MedNet |
| Synonyms | Source |
|---|---|
| Dymethazine | ChEMBL |
| Roxilon | ChEMBL |